(4-methoxycarbonylphenyl) 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: (4-methoxycarbonylphenyl) 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: (4-methoxycarbonylphenyl) 4-methoxy-3-[(2-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-methoxy-3-[(2-methyl-1-piperidinyl)sulfonyl]benzoic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-methoxy-3-(2-methylpiperidino)sulfonyl-benzoic acid (4-carbomethoxyphenyl) ester Formula: C22H25NO7S MolecularWeight: 447.5014

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)C(=O)OC)OC

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C22H25NO7S/c1-15-6-4-5-13-23(15)31(26,27)20-14-17(9-12-19(20)28-2)22(25)30-18-10-7-16(8-11-18)21(24)29-3/h7-12,14-15H,4-6,13H2,1-3H3